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2-Benzoylthio-4-(4-chlorophenyl)-3-morpholinopyrrole
SpectraBase Compound ID 2mlTQoN0kPZ
InChI InChI=1S/C21H19ClN2O2S/c22-17-8-6-15(7-9-17)18-14-23-20(19(18)24-10-12-26-13-11-24)27-21(25)16-4-2-1-3-5-16/h1-9,14,23H,10-13H2
InChIKey HSBZMLWJRUEFGQ-UHFFFAOYSA-N
Mol Weight 398.91 g/mol
Molecular Formula C21H19ClN2O2S
Exact Mass 398.085577 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JCuArZOoZ07
Name 2-Benzoylthio-4-(4-chlorophenyl)-3-morpholinopyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19ClN2O2S
InChI InChI=1S/C21H19ClN2O2S/c22-17-8-6-15(7-9-17)18-14-23-20(19(18)24-10-12-26-13-11-24)27-21(25)16-4-2-1-3-5-16/h1-9,14,23H,10-13H2
InChIKey HSBZMLWJRUEFGQ-UHFFFAOYSA-N
Molecular Weight 398.908 g/mol
SMILES [nH]1cc(c(c1SC(=O)c1ccccc1)N1CCOCC1)-c1ccc(cc1)Cl
SPLASH splash10-0a4i-4963100000-24d19a79c05b54f1c8c0
Source of Spectrum KC-0-2342-8
Synonyms S-[4-(4-chlorophenyl)-3-(4-morpholinyl)-1H-pyrrol-2-yl]benzenecarbothioate benzenecarbothioic acid S-[4-(4-chlorophenyl)-3-(4-morpholinyl)-1H-pyrrol-2-yl] ester S-[4-(4-chlorophenyl)-3-morpholino-1H-pyrrol-2-yl] benzenecarbothioate S-[4-(4-chlorophenyl)-3-morpholin-4-yl-1H-pyrrol-2-yl] benzenecarbothioate
Wiley ID 786483